# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.89847555
_cell_length_b   12.15658874
_cell_length_c   49.62234399
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.28293109
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al108 Cu54'
_cell_volume   6260.42598918
_cell_formula_units_Z   54
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Al  Al1  1  0.214921  0.762961  0.341051  1
  Al  Al2  1  0.767732  0.744923  0.323252  1
  Al  Al3  1  0.550867  0.111496  0.328693  1
  Al  Al4  1  0.945715  0.468015  0.323231  1
  Al  Al5  1  0.945648  0.083763  0.333416  1
  Al  Al6  1  0.327379  0.441716  0.326261  1
  Al  Al7  1  0.421432  0.700869  0.353860  1
  Al  Al8  1  0.796442  0.609781  0.363960  1
  Al  Al9  1  0.807540  0.201460  0.328431  1
  Al  Al10  1  0.276691  0.621359  0.307328  1
  Al  Al11  1  0.213356  0.185256  0.322730  1
  Al  Al12  1  0.727689  0.503087  0.314457  1
  Al  Al13  1  0.597169  0.435166  0.393073  1
  Al  Al14  1  0.146642  0.449769  0.403576  1
  Al  Al15  1  0.286370  0.019869  0.346780  1
  Al  Al16  1  0.716036  0.353583  0.355481  1
  Al  Al17  1  0.666585  0.905808  0.347714  1
  Al  Al18  1  0.126116  0.290073  0.362220  1
  Al  Al19  1  0.010814  0.584094  0.371305  1
  Al  Al20  1  0.377860  0.504697  0.380712  1
  Al  Al21  1  0.440981  0.927165  0.365646  1
  Al  Al22  1  0.920785  0.334244  0.373177  1
  Al  Al23  1  0.865635  0.880709  0.366850  1
  Al  Al24  1  0.344449  0.278436  0.372288  1
  Al  Al25  1  0.402177  0.392322  0.425187  1
  Al  Al26  1  0.930098  0.339009  0.428667  1
  Al  Al27  1  0.844913  0.720269  0.411363  1
  Al  Al28  1  0.280488  0.104997  0.415222  1
  Al  Al29  1  0.330890  0.795635  0.440753  1
  Al  Al30  1  0.726903  0.070303  0.428532  1
  Al  Al31  1  0.717584  0.254370  0.459677  1
  Al  Al32  1  0.197248  0.363902  0.454362  1
  Al  Al33  1  0.052599  0.822492  0.375609  1
  Al  Al34  1  0.488974  0.172342  0.378673  1
  Al  Al35  1  0.520019  0.824230  0.402967  1
  Al  Al36  1  0.905069  0.114522  0.388659  1
  Al  Al37  1  0.026383  0.135433  0.499549  1
  Al  Al38  1  0.514781  0.191779  0.492187  1
  Al  Al39  1  0.601212  0.639387  0.429967  1
  Al  Al40  1  1.000562  0.981187  0.413324  1
  Al  Al41  1  0.067491  0.662206  0.421484  1
  Al  Al42  1  0.489654  0.028437  0.418730  1
  Al  Al43  1  0.350005  0.247954  0.468128  1
  Al  Al44  1  0.983266  0.327828  0.484098  1
  Al  Al45  1  0.883286  0.691050  0.461018  1
  Al  Al46  1  0.309684  0.997301  0.466154  1
  Al  Al47  1  0.393866  0.627500  0.475907  1
  Al  Al48  1  0.774204  0.058328  0.483346  1
  Al  Al49  1  0.850854  0.168030  0.533553  1
  Al  Al50  1  0.237837  0.115773  0.511740  1
  Al  Al51  1  0.180764  0.569746  0.503743  1
  Al  Al52  1  0.574256  0.799277  0.509788  1
  Al  Al53  1  0.699755  0.460896  0.496711  1
  Al  Al54  1  0.056402  0.902322  0.490358  1
  Al  Al55  1  0.076587  0.920379  0.545975  1
  Al  Al56  1  0.586119  0.027292  0.519839  1
  Al  Al57  1  0.496598  0.484533  0.478308  1
  Al  Al58  1  0.866994  0.915397  0.459287  1
  Al  Al59  1  0.911553  0.494013  0.465673  1
  Al  Al60  1  0.361662  0.820477  0.494030  1
  Al  Al61  1  0.474075  0.007127  0.576827  1
  Al  Al62  1  0.810715  0.798405  0.562030  1
  Al  Al63  1  0.084645  0.370503  0.535402  1
  Al  Al64  1  0.388769  0.786796  0.547509  1
  Al  Al65  1  0.452585  0.339957  0.525350  1
  Al  Al66  1  0.874942  0.698964  0.515085  1
  Al  Al67  1  0.694987  0.939026  0.553964  1
  Al  Al68  1  0.217503  0.845488  0.577823  1
  Al  Al69  1  0.210574  0.251943  0.552863  1
  Al  Al70  1  0.624443  0.608840  0.527407  1
  Al  Al71  1  0.580801  0.217336  0.544405  1
  Al  Al72  1  0.143520  0.762826  0.524265  1
  Al  Al73  1  0.011864  0.605420  0.605317  1
  Al  Al74  1  0.516799  0.617777  0.612813  1
  Al  Al75  1  0.723880  0.158922  0.581200  1
  Al  Al76  1  0.142344  0.591340  0.559650  1
  Al  Al77  1  0.105813  0.060832  0.592290  1
  Al  Al78  1  0.499761  0.460976  0.571805  1
  Al  Al79  1  0.311708  0.692179  0.601030  1
  Al  Al80  1  0.751725  0.622951  0.599071  1
  Al  Al81  1  0.843033  0.009845  0.598910  1
  Al  Al82  1  0.281340  0.476663  0.577325  1
  Al  Al83  1  0.326012  0.064810  0.612647  1
  Al  Al84  1  0.721408  0.467349  0.552885  1
  Al  Al85  1  0.757673  0.401489  0.607042  1
  Al  Al86  1  0.277001  0.458433  0.634019  1
  Al  Al87  1  0.171006  0.832145  0.634374  1
  Al  Al88  1  0.574896  0.188846  0.633646  1
  Al  Al89  1  0.690888  0.839327  0.639958  1
  Al  Al90  1  0.066320  0.209012  0.628016  1
  Al  Al91  1  0.893555  0.463356  0.652626  1
  Al  Al92  1  0.456360  0.483950  0.670320  1
  Al  Al93  1  0.426306  0.917995  0.629925  1
  Al  Al94  1  0.899359  0.391886  0.565402  1
  Al  Al95  1  0.944854  0.922390  0.635648  1
  Al  Al96  1  0.309459  0.285439  0.605302  1
  Al  Al97  1  0.212539  0.284532  0.674580  1
  Al  Al98  1  0.751010  0.216214  0.670943  1
  Al  Al99  1  0.919563  0.692443  0.644197  1
  Al  Al100  1  0.361474  0.032463  0.669169  1
  Al  Al101  1  0.431584  0.711522  0.649926  1
  Al  Al102  1  0.868673  0.073185  0.662541  1
  Al  Al103  1  0.648868  0.394488  0.667585  1
  Al  Al104  1  0.039692  0.362762  0.664496  1
  Al  Al105  1  0.057464  0.640242  0.686457  1
  Al  Al106  1  0.575473  0.945371  0.675043  1
  Al  Al107  1  0.587474  0.723039  0.688951  1
  Al  Al108  1  0.081907  0.871926  0.680759  1
  Cu  Cu109  1  0.462363  0.861846  0.316000  1
  Cu  Cu110  1  0.042377  0.927329  0.328603  1
  Cu  Cu111  1  0.068804  0.340418  0.316552  1
  Cu  Cu112  1  0.529526  0.674340  0.313632  1
  Cu  Cu113  1  0.485404  0.292786  0.331606  1
  Cu  Cu114  1  0.971695  0.696500  0.326901  1
  Cu  Cu115  1  0.262214  0.690212  0.390680  1
  Cu  Cu116  1  0.628595  0.696365  0.377602  1
  Cu  Cu117  1  0.681556  0.099529  0.374976  1
  Cu  Cu118  1  0.171960  0.519332  0.352018  1
  Cu  Cu119  1  0.119017  0.071627  0.369922  1
  Cu  Cu120  1  0.556478  0.517135  0.345460  1
  Cu  Cu121  1  0.836046  0.493885  0.410068  1
  Cu  Cu122  1  0.366799  0.603844  0.425676  1
  Cu  Cu123  1  0.260176  0.893448  0.399620  1
  Cu  Cu124  1  0.701474  0.266108  0.406601  1
  Cu  Cu125  1  0.749775  0.879897  0.412295  1
  Cu  Cu126  1  0.153263  0.230842  0.411048  1
  Cu  Cu127  1  0.673086  0.470120  0.445044  1
  Cu  Cu128  1  0.154683  0.550632  0.451872  1
  Cu  Cu129  1  0.103101  0.873965  0.437938  1
  Cu  Cu130  1  0.514708  0.244139  0.434844  1
  Cu  Cu131  1  0.594288  0.836987  0.454821  1
  Cu  Cu132  1  0.964892  0.155875  0.444853  1
  Cu  Cu133  1  0.253665  0.356475  0.503155  1
  Cu  Cu134  1  0.772073  0.300557  0.510758  1
  Cu  Cu135  1  0.690231  0.708797  0.479543  1
  Cu  Cu136  1  0.126550  0.089395  0.456492  1
  Cu  Cu137  1  0.119993  0.726047  0.473357  1
  Cu  Cu138  1  0.541766  0.009098  0.467736  1
  Cu  Cu139  1  0.965556  0.051949  0.550327  1
  Cu  Cu140  1  0.323931  0.118434  0.561754  1
  Cu  Cu141  1  0.376146  0.556991  0.528675  1
  Cu  Cu142  1  0.832834  0.898477  0.512794  1
  Cu  Cu143  1  0.948390  0.521538  0.519031  1
  Cu  Cu144  1  0.350419  0.987000  0.526639  1
  Cu  Cu145  1  0.563638  0.858134  0.598100  1
  Cu  Cu146  1  0.996331  0.817859  0.596239  1
  Cu  Cu147  1  0.999410  0.238025  0.579814  1
  Cu  Cu148  1  0.535626  0.695736  0.564075  1
  Cu  Cu149  1  0.519341  0.264786  0.589192  1
  Cu  Cu150  1  0.950894  0.658176  0.560243  1
  Cu  Cu151  1  0.164148  0.606447  0.643965  1
  Cu  Cu152  1  0.683082  0.626704  0.651539  1
  Cu  Cu153  1  0.681019  0.047219  0.628814  1
  Cu  Cu154  1  0.079709  0.436606  0.606791  1
  Cu  Cu155  1  0.174038  0.075895  0.648351  1
  Cu  Cu156  1  0.554717  0.428914  0.623282  1
  Cu  Cu157  1  0.818354  0.609373  0.689991  1
  Cu  Cu158  1  0.264585  0.548814  0.682789  1
  Cu  Cu159  1  0.298735  0.794138  0.675826  1
  Cu  Cu160  1  0.871161  0.261892  0.622909  1
  Cu  Cu161  1  0.834973  0.823142  0.680468  1
  Cu  Cu162  1  0.399932  0.253764  0.651675  1
